1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine

C10H18N4 — CID 61377993

IUPAC1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine
SMILESCCn1c(C)nnc1C1(N)CCCC1
InChIInChI=1S/C10H18N4/c1-3-14-8(2)12-13-9(14)10(11)6-4-5-7-10/h3-7,11H2,1-2H3
InChIKeyOWSNOTLUSUNDDW-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.33
Rot. Bonds2

About 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine

1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine (PubChem CID 61377993) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine
PubChem CID61377993
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine
SMILESCCn1c(C)nnc1C1(N)CCCC1
InChIInChI=1S/C10H18N4/c1-3-14-8(2)12-13-9(14)10(11)6-4-5-7-10/h3-7,11H2,1-2H3
InChIKeyOWSNOTLUSUNDDW-UHFFFAOYSA-N
XLogP1.33
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine?
The IUPAC name of 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine (CID 61377993) is 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine.
What is the SMILES notation for 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine?
The canonical SMILES for 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine is CCn1c(C)nnc1C1(N)CCCC1.
What is the InChIKey of 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine?
The InChIKey is OWSNOTLUSUNDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-3-14-8(2)12-13-9(14)10(11)6-4-5-7-10/h3-7,11H2,1-2H3.
What are the key properties of 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine?
1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine has a molecular weight of 194.28 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine is sourced from PubChem (CID 61377993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).